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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > cyanides > nitrile > (8r,9r,10r)-9-[4-(3-cyanophenyl)phenyl]-10-(hydroxymethyl)-n-phenyl-1,6-diazabicyclo[6.2.0]decane-6-carboxamide

Preferred term

(8r,9r,10r)-9-[4-(3-cyanophenyl)phenyl]-10-(hydroxymethyl)-n-phenyl-1,6-diazabicyclo[6.2.0]decane-6-carboxamide  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C29H30N4O2

inchi

  • InChI=1S/C29H30N4O2/c30-18-21-7-6-8-24(17-21)22-11-13-23(14-12-22)28-26-19-32(15-4-5-16-33(26)27(28)20-34)29(35)31-25-9-2-1-3-10-25/h1-3,6-14,17,26-28,34H,4-5,15-16,19-20H2,(H,31,35)/t26-,27-,28+/m0/s1

inchikey

  • XVJXRFRHWWJGLK-HZFUHODCSA-N

mass

  • 466.575

monoisotopicmass

  • 466.23688

smiles

  • C1CCN2[C@@H](CN(C1)C(=O)NC3=CC=CC=C3)[C@H]([C@@H]2CO)C4=CC=C(C=C4)C5=CC=CC(=C5)C#N

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:126117

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